Information card for entry 7012279

Structure parameters

• Formula: C64.5 H47 Cl3 O12 P4 Pt Ru5
• Calculated formula: C64.5 H47 Cl3 O12 P4 Pt Ru5
• SMILES: [C]12345[Pt]6789([Ru]%10%11%121([Ru]1%1326([Ru]237([Ru]48%10([Ru]5%1112(C#[O])(C#[O])C#[O])([P](C[P]%12(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O])([P](C[P]%13(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O])(C9=O)C#[O])(C#[O])C#[O])C#[O].C(Cl)Cl.C(Cl)Cl
• Title of publication: Ligand substitutions in Ru‒Pt clusters: isolation of compounds with unusual geometries
• Authors of publication: Hermans, Sophie; Khimyak, Tetyana; Feeder, Neil; Teat, Simon J.; Johnson, Brian F. G.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 4
• Pages of publication: 672
• a: 13.328 ± 0.001 Å
• b: 17.705 ± 0.001 Å
• c: 56.071 ± 0.003 Å
• α: 90°
• β: 96.71 ± 0.01°
• γ: 90°
• Cell volume: 13140.6 ± 1.4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1015
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections: 0.1786
• Weighted residual factors for significantly intense reflections: 0.1103
• Goodness-of-fit parameter for all reflections: 0.996
• Goodness-of-fit parameter for significantly intense reflections: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No